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Benzene and substituted derivatives

Benzene is an aromatic organic molecule composed of six carbon atoms and six hydrogen atoms that form a ring. Includes substituted derivative compounds.
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4,561 – 4,575 of 57,266 results
4,561

3-(Aminomethyl)benzeneboronic acid hydrochloride, 96%

CAS: 352525-94-1 Molecular Formula: C7H11BClNO2 Molecular Weight (g/mol): 187.43 MDL Number: MFCD02093050 InChI Key: NPTBTFRGCBFYPZ-UHFFFAOYSA-N Synonym: 3-aminomethyl phenyl boronic acid hydrochloride,3-aminomethyl phenylboronic acid hydrochloride,3-aminomethylphenylboronic acid hydrochloride,3-aminomethylphenyl boronic acid hydrochloride,3-aminomethylphenylboronic acid hcl,3-aminomethylphenyl boronic acid hcl,boronic acid, 3-aminomethyl phenyl-, hydrochloride,3-aminomethylphenylboronic acid, hcl PubChem CID: 16427085 IUPAC Name: [3-(aminomethyl)phenyl]boronic acid;hydrochloride SMILES: B(C1=CC(=CC=C1)CN)(O)O.Cl

PubChem CID 16427085
CAS 352525-94-1
Molecular Weight (g/mol) 187.43
MDL Number MFCD02093050
SMILES B(C1=CC(=CC=C1)CN)(O)O.Cl
Synonym 3-aminomethyl phenyl boronic acid hydrochloride,3-aminomethyl phenylboronic acid hydrochloride,3-aminomethylphenylboronic acid hydrochloride,3-aminomethylphenyl boronic acid hydrochloride,3-aminomethylphenylboronic acid hcl,3-aminomethylphenyl boronic acid hcl,boronic acid, 3-aminomethyl phenyl-, hydrochloride,3-aminomethylphenylboronic acid, hcl
IUPAC Name [3-(aminomethyl)phenyl]boronic acid;hydrochloride
InChI Key NPTBTFRGCBFYPZ-UHFFFAOYSA-N
Molecular Formula C7H11BClNO2
4,562

3,5-Di-tert-butylcatechol, 99%

CAS: 1020-31-1 Molecular Formula: C14H22O2 Molecular Weight (g/mol): 222.328 MDL Number: MFCD00008819 InChI Key: PJZLSMMERMMQBJ-UHFFFAOYSA-N Synonym: 3,5-di-tert-butylcatechol,3,5-di-t-butylcatechol,3,5-di-tert-butylbenzene-1,2-diol,3,5-di-tert-butylpyrocatechol,1,2-benzenediol, 3,5-bis 1,1-dimethylethyl,4,6-di-tert-butylpyrocatechol,unii-1328kn3f8b,1,2-benzenediol, 3,5-di 1,1-dimethylethyl,pyrocatechol, 3,5-di-tert-butyl,3,5-bis tert-butyl benzene-1,2-diol PubChem CID: 66099 IUPAC Name: 3,5-ditert-butylbenzene-1,2-diol SMILES: CC(C)(C)C1=CC(=C(C(=C1)O)O)C(C)(C)C

PubChem CID 66099
CAS 1020-31-1
Molecular Weight (g/mol) 222.328
MDL Number MFCD00008819
SMILES CC(C)(C)C1=CC(=C(C(=C1)O)O)C(C)(C)C
Synonym 3,5-di-tert-butylcatechol,3,5-di-t-butylcatechol,3,5-di-tert-butylbenzene-1,2-diol,3,5-di-tert-butylpyrocatechol,1,2-benzenediol, 3,5-bis 1,1-dimethylethyl,4,6-di-tert-butylpyrocatechol,unii-1328kn3f8b,1,2-benzenediol, 3,5-di 1,1-dimethylethyl,pyrocatechol, 3,5-di-tert-butyl,3,5-bis tert-butyl benzene-1,2-diol
IUPAC Name 3,5-ditert-butylbenzene-1,2-diol
InChI Key PJZLSMMERMMQBJ-UHFFFAOYSA-N
Molecular Formula C14H22O2
4,563

4-Bromobenzyl alcohol, 99%

CAS: 873-75-6 Molecular Formula: C7H7BrO Molecular Weight (g/mol): 187.04 MDL Number: MFCD00004650 InChI Key: VEDDBHYQWFOITD-UHFFFAOYSA-N Synonym: 4-bromobenzyl alcohol,4-bromophenyl methanol,p-bromobenzyl alcohol,benzenemethanol, 4-bromo,para-bromobenzyl alcohol,4-bromobenzylalcohol,p-bromo-benzyl alcohol,ccris 5119,4-bromophenyl-methanol,benzyl alcohol, p-bromo PubChem CID: 70119 IUPAC Name: (4-bromophenyl)methanol SMILES: C1=CC(=CC=C1CO)Br

PubChem CID 70119
CAS 873-75-6
Molecular Weight (g/mol) 187.04
MDL Number MFCD00004650
SMILES C1=CC(=CC=C1CO)Br
Synonym 4-bromobenzyl alcohol,4-bromophenyl methanol,p-bromobenzyl alcohol,benzenemethanol, 4-bromo,para-bromobenzyl alcohol,4-bromobenzylalcohol,p-bromo-benzyl alcohol,ccris 5119,4-bromophenyl-methanol,benzyl alcohol, p-bromo
IUPAC Name (4-bromophenyl)methanol
InChI Key VEDDBHYQWFOITD-UHFFFAOYSA-N
Molecular Formula C7H7BrO
4,564

Capsaicin, USP, Spectrum™ Chemical
SDP

CAS: 404-86-4 Molecular Formula: C18H27NO3 Molecular Weight (g/mol): 305.42 InChI Key: YKPUWZUDDOIDPM-SOFGYWHQSA-N IUPAC Name: (6E)-N-[(4-hydroxy-3-methoxyphenyl)methyl]-8-methylnon-6-enamide SMILES: COC1=CC(CNC(=O)CCCC\C=C\C(C)C)=CC=C1O

CAS 404-86-4
Molecular Weight (g/mol) 305.42
SMILES COC1=CC(CNC(=O)CCCC\C=C\C(C)C)=CC=C1O
IUPAC Name (6E)-N-[(4-hydroxy-3-methoxyphenyl)methyl]-8-methylnon-6-enamide
InChI Key YKPUWZUDDOIDPM-SOFGYWHQSA-N
Molecular Formula C18H27NO3
4,565

Dichloro[bis(diphenylphosphinophenyl)ether]palladium(II), Pd 13% min

CAS: 205319-06-8 Molecular Formula: C36H28Cl2OP2Pd Molecular Weight (g/mol): 715.89 MDL Number: MFCD09953446 InChI Key: QZIOEBWDZNUTLZ-UHFFFAOYSA-L Synonym: dichloro bis diphenylphosphinophenyl ether palladium ii,dichloro bis 2-diphenylphosphino phenyl ether palladium ii,bis diphenylphosphinophenyl ether palladium ii dichloride,dichloro bis diphenylphosphinophenyl ether palladium ii , pd,oxydi 2,1-phenylene bis diphenylphosphane-dichloropalladium 1/1,palladium chloride; 2-2-diphenylphosphanyl phenoxy phenyl diphenylphosphane PubChem CID: 11377567 IUPAC Name: dichloropalladium;[2-(2-diphenylphosphanylphenoxy)phenyl]-diphenylphosphane SMILES: Cl[Pd++]Cl.O(C1=CC=CC=C1P(C1=CC=CC=C1)C1=CC=CC=C1)C1=CC=CC=C1P(C1=CC=CC=C1)C1=CC=CC=C1

PubChem CID 11377567
CAS 205319-06-8
Molecular Weight (g/mol) 715.89
MDL Number MFCD09953446
SMILES Cl[Pd++]Cl.O(C1=CC=CC=C1P(C1=CC=CC=C1)C1=CC=CC=C1)C1=CC=CC=C1P(C1=CC=CC=C1)C1=CC=CC=C1
Synonym dichloro bis diphenylphosphinophenyl ether palladium ii,dichloro bis 2-diphenylphosphino phenyl ether palladium ii,bis diphenylphosphinophenyl ether palladium ii dichloride,dichloro bis diphenylphosphinophenyl ether palladium ii , pd,oxydi 2,1-phenylene bis diphenylphosphane-dichloropalladium 1/1,palladium chloride; 2-2-diphenylphosphanyl phenoxy phenyl diphenylphosphane
IUPAC Name dichloropalladium;[2-(2-diphenylphosphanylphenoxy)phenyl]-diphenylphosphane
InChI Key QZIOEBWDZNUTLZ-UHFFFAOYSA-L
Molecular Formula C36H28Cl2OP2Pd
4,566

Methyl salicylate, 98%

CAS: 119-36-8 Molecular Formula: C8H8O3 Molecular Weight (g/mol): 152.149 MDL Number: MFCD00002214 InChI Key: OSWPMRLSEDHDFF-UHFFFAOYSA-N Synonym: methyl salicylate,wintergreen oil,gaultheria oil,betula oil,teaberry oil,sweet birch oil,oil of wintergreen,analgit,spicewood oil,2-hydroxybenzoic acid methyl ester PubChem CID: 4133 ChEBI: CHEBI:31832 IUPAC Name: methyl 2-hydroxybenzoate SMILES: COC(=O)C1=CC=CC=C1O

PubChem CID 4133
CAS 119-36-8
Molecular Weight (g/mol) 152.149
ChEBI CHEBI:31832
MDL Number MFCD00002214
SMILES COC(=O)C1=CC=CC=C1O
Synonym methyl salicylate,wintergreen oil,gaultheria oil,betula oil,teaberry oil,sweet birch oil,oil of wintergreen,analgit,spicewood oil,2-hydroxybenzoic acid methyl ester
IUPAC Name methyl 2-hydroxybenzoate
InChI Key OSWPMRLSEDHDFF-UHFFFAOYSA-N
Molecular Formula C8H8O3
4,567

2,4,6-Triisopropylbenzenesulfonyl chloride, 98%

CAS: 6553-96-4 Molecular Formula: C15H23ClO2S Molecular Weight (g/mol): 302.857 MDL Number: MFCD00007433 InChI Key: JAPYIBBSTJFDAK-UHFFFAOYSA-N Synonym: 2,4,6-triisopropylbenzenesulfonyl chloride,2,4,6-triisopropylbenzene-1-sulfonyl chloride,trisyl chloride,2,4,6-triisopropylbenzenesulphonyl chloride,benzenesulfonyl chloride, 2,4,6-tris 1-methylethyl,2,4,6-triisopropylbenzenesulfonylchloride,2,4,6-triisopropyl-benzenesulfonyl chloride,tpscl 2,4,6-triisopropyl benzenesulfonyl chloride,2,4,6-triisopropylphenylsulfonyl chloride,2,4,6-triisopropyl benzenesulfonyl chloride PubChem CID: 81042 IUPAC Name: 2,4,6-tri(propan-2-yl)benzenesulfonyl chloride SMILES: CC(C)C1=CC(=C(C(=C1)C(C)C)S(=O)(=O)Cl)C(C)C

PubChem CID 81042
CAS 6553-96-4
Molecular Weight (g/mol) 302.857
MDL Number MFCD00007433
SMILES CC(C)C1=CC(=C(C(=C1)C(C)C)S(=O)(=O)Cl)C(C)C
Synonym 2,4,6-triisopropylbenzenesulfonyl chloride,2,4,6-triisopropylbenzene-1-sulfonyl chloride,trisyl chloride,2,4,6-triisopropylbenzenesulphonyl chloride,benzenesulfonyl chloride, 2,4,6-tris 1-methylethyl,2,4,6-triisopropylbenzenesulfonylchloride,2,4,6-triisopropyl-benzenesulfonyl chloride,tpscl 2,4,6-triisopropyl benzenesulfonyl chloride,2,4,6-triisopropylphenylsulfonyl chloride,2,4,6-triisopropyl benzenesulfonyl chloride
IUPAC Name 2,4,6-tri(propan-2-yl)benzenesulfonyl chloride
InChI Key JAPYIBBSTJFDAK-UHFFFAOYSA-N
Molecular Formula C15H23ClO2S
4,568

2,5-Difluorobenzyl bromide, 98%

CAS: 85117-99-3 Molecular Formula: C7H5BrF2 Molecular Weight (g/mol): 207.02 MDL Number: MFCD00009897 InChI Key: ONWGSWNHQZYCFK-UHFFFAOYSA-N Synonym: 2,5-difluorobenzyl bromide,2-bromomethyl-1,4-difluorobenzene,2,5-difluorobenzylbromide,alpha-bromo-2,5-difluorotoluene,benzene, 2-bromomethyl-1,4-difluoro,timtec-bb sbb006680,2-bromomethyl-1,4-difluoro-benzene,pubchem10213,2,2-difluorobenzylbromide,acmc-209q4i PubChem CID: 522830 IUPAC Name: 2-(bromomethyl)-1,4-difluorobenzene SMILES: FC1=CC=C(F)C(CBr)=C1

PubChem CID 522830
CAS 85117-99-3
Molecular Weight (g/mol) 207.02
MDL Number MFCD00009897
SMILES FC1=CC=C(F)C(CBr)=C1
Synonym 2,5-difluorobenzyl bromide,2-bromomethyl-1,4-difluorobenzene,2,5-difluorobenzylbromide,alpha-bromo-2,5-difluorotoluene,benzene, 2-bromomethyl-1,4-difluoro,timtec-bb sbb006680,2-bromomethyl-1,4-difluoro-benzene,pubchem10213,2,2-difluorobenzylbromide,acmc-209q4i
IUPAC Name 2-(bromomethyl)-1,4-difluorobenzene
InChI Key ONWGSWNHQZYCFK-UHFFFAOYSA-N
Molecular Formula C7H5BrF2
4,569

2-Isopropylanisole, 98%

CAS: 2944-47-0 Molecular Formula: C10H14O Molecular Weight (g/mol): 150.221 MDL Number: MFCD00798590 InChI Key: NNZRVXTXKISCGS-UHFFFAOYSA-N Synonym: 1-isopropyl-2-methoxybenzene,2-isopropylanisole,o-isopropylanisole,anisole, o-isopropyl,benzene, 1-methoxy-2-1-methylethyl,2-o-methoxyphenyl propane,1-methoxy-2-propan-2-yl benzene,isopropylanisol,isopropyl anisole,acmc-20ansj PubChem CID: 270623 IUPAC Name: 1-methoxy-2-propan-2-ylbenzene SMILES: CC(C)C1=CC=CC=C1OC

PubChem CID 270623
CAS 2944-47-0
Molecular Weight (g/mol) 150.221
MDL Number MFCD00798590
SMILES CC(C)C1=CC=CC=C1OC
Synonym 1-isopropyl-2-methoxybenzene,2-isopropylanisole,o-isopropylanisole,anisole, o-isopropyl,benzene, 1-methoxy-2-1-methylethyl,2-o-methoxyphenyl propane,1-methoxy-2-propan-2-yl benzene,isopropylanisol,isopropyl anisole,acmc-20ansj
IUPAC Name 1-methoxy-2-propan-2-ylbenzene
InChI Key NNZRVXTXKISCGS-UHFFFAOYSA-N
Molecular Formula C10H14O
4,570

1-Bromo-4-nitrobenzene, 98%

CAS: 586-78-7 Molecular Formula: C6H4BrNO2 Molecular Weight (g/mol): 202.01 MDL Number: MFCD00007280 InChI Key: ZDFBKZUDCQQKAC-UHFFFAOYSA-N Synonym: 4-bromonitrobenzene,4-nitrobromobenzene,p-bromonitrobenzene,benzene, 1-bromo-4-nitro,p-nitrobromobenzene,4-nitrophenyl bromide,4-bromo-1-nitrobenzene,p-nitrophenyl bromide,1-bromo-4-nitro-benzene,ccris 3115 PubChem CID: 11466 IUPAC Name: 1-bromo-4-nitrobenzene SMILES: [O-][N+](=O)C1=CC=C(Br)C=C1

PubChem CID 11466
CAS 586-78-7
Molecular Weight (g/mol) 202.01
MDL Number MFCD00007280
SMILES [O-][N+](=O)C1=CC=C(Br)C=C1
Synonym 4-bromonitrobenzene,4-nitrobromobenzene,p-bromonitrobenzene,benzene, 1-bromo-4-nitro,p-nitrobromobenzene,4-nitrophenyl bromide,4-bromo-1-nitrobenzene,p-nitrophenyl bromide,1-bromo-4-nitro-benzene,ccris 3115
IUPAC Name 1-bromo-4-nitrobenzene
InChI Key ZDFBKZUDCQQKAC-UHFFFAOYSA-N
Molecular Formula C6H4BrNO2
4,571

trans-beta-Styrylboronic acid pinacol ester, 98%

CAS: 83947-56-2 Molecular Formula: C14H19BO2 Molecular Weight (g/mol): 230.11 MDL Number: MFCD03453666 InChI Key: ARAINKADEARZLZ-ZHACJKMWSA-N Synonym: e-4,4,5,5-tetramethyl-2-styryl-1,3,2-dioxaborolane,e-phenylethenylboronic acid, pinacol ester,trans-styrylboronic acid, pinacol ester,beta-styrylboronic acid pinacol ester,trans-2-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl styrene,4,4,5,5-tetramethyl-2-styryl-1,3,2-dioxaborolane,trans-beta-styrylboronic acid pinacol ester,trans-2-phenylvinylboronic acid pinacol ester,4,4,5,5-tetramethyl-2-e-2-phenylethenyl-1,3,2-dioxaborolane,4,4,5,5-tetramethyl-2-e-2-phenylvinyl-1,3,2-dioxaborolane PubChem CID: 5708413 SMILES: CC1(C)OB(OC1(C)C)\C=C\C1=CC=CC=C1

PubChem CID 5708413
CAS 83947-56-2
Molecular Weight (g/mol) 230.11
MDL Number MFCD03453666
SMILES CC1(C)OB(OC1(C)C)\C=C\C1=CC=CC=C1
Synonym e-4,4,5,5-tetramethyl-2-styryl-1,3,2-dioxaborolane,e-phenylethenylboronic acid, pinacol ester,trans-styrylboronic acid, pinacol ester,beta-styrylboronic acid pinacol ester,trans-2-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl styrene,4,4,5,5-tetramethyl-2-styryl-1,3,2-dioxaborolane,trans-beta-styrylboronic acid pinacol ester,trans-2-phenylvinylboronic acid pinacol ester,4,4,5,5-tetramethyl-2-e-2-phenylethenyl-1,3,2-dioxaborolane,4,4,5,5-tetramethyl-2-e-2-phenylvinyl-1,3,2-dioxaborolane
InChI Key ARAINKADEARZLZ-ZHACJKMWSA-N
Molecular Formula C14H19BO2
4,572

4-Bromo-3-methylbenzamide, 99%

CAS: 170229-98-8 Molecular Formula: C8H8BrNO Molecular Weight (g/mol): 214.062 MDL Number: MFCD00672914 InChI Key: ZPFPOZMNEKPBIF-UHFFFAOYSA-N Synonym: benzamide,4-bromo-3-methyl,pubchem3804,4-bromo-3-methyl-benzamide,acmc-1c5o5,4-bromanyl-3-methyl-benzamide PubChem CID: 7020869 IUPAC Name: 4-bromo-3-methylbenzamide SMILES: CC1=C(C=CC(=C1)C(=O)N)Br

PubChem CID 7020869
CAS 170229-98-8
Molecular Weight (g/mol) 214.062
MDL Number MFCD00672914
SMILES CC1=C(C=CC(=C1)C(=O)N)Br
Synonym benzamide,4-bromo-3-methyl,pubchem3804,4-bromo-3-methyl-benzamide,acmc-1c5o5,4-bromanyl-3-methyl-benzamide
IUPAC Name 4-bromo-3-methylbenzamide
InChI Key ZPFPOZMNEKPBIF-UHFFFAOYSA-N
Molecular Formula C8H8BrNO
4,573

4-Methyl-2-nitroaniline, 99%

CAS: 89-62-3 Molecular Formula: C7H8N2O2 Molecular Weight (g/mol): 152.15 MDL Number: MFCD00007907 InChI Key: DLURHXYXQYMPLT-UHFFFAOYSA-N Synonym: 2-nitro-p-toluidine,4-amino-3-nitrotoluene,3-nitro-4-toluidine,fast red gl,3-nitro-4-aminotoluene,fast red gl base,benzenamine, 4-methyl-2-nitro,2-nitro-4-methylaniline,4-methyl-6-nitroaniline,mnpt PubChem CID: 6978 ChEBI: CHEBI:66920 IUPAC Name: 4-methyl-2-nitroaniline SMILES: CC1=CC=C(N)C(=C1)[N+]([O-])=O

PubChem CID 6978
CAS 89-62-3
Molecular Weight (g/mol) 152.15
ChEBI CHEBI:66920
MDL Number MFCD00007907
SMILES CC1=CC=C(N)C(=C1)[N+]([O-])=O
Synonym 2-nitro-p-toluidine,4-amino-3-nitrotoluene,3-nitro-4-toluidine,fast red gl,3-nitro-4-aminotoluene,fast red gl base,benzenamine, 4-methyl-2-nitro,2-nitro-4-methylaniline,4-methyl-6-nitroaniline,mnpt
IUPAC Name 4-methyl-2-nitroaniline
InChI Key DLURHXYXQYMPLT-UHFFFAOYSA-N
Molecular Formula C7H8N2O2
4,574

1-Bromo-4-isopropylbenzene, 97%

CAS: 586-61-8 Molecular Formula: C9H11Br Molecular Weight (g/mol): 199.09 MDL Number: MFCD00039159 InChI Key: MOZHUOIQYVYEPN-UHFFFAOYSA-N Synonym: 1-bromo-4-isopropylbenzene,4-bromocumene,4-bromoisopropylbenzene,p-bromocumene,4-isopropylbromobenzene,benzene, 1-bromo-4-1-methylethyl,p-bromoisopropylbenzene,2-p-bromophenyl propane,cumene, p-bromo,2-4-bromophenyl propane PubChem CID: 11462 IUPAC Name: 1-bromo-4-propan-2-ylbenzene SMILES: CC(C)C1=CC=C(Br)C=C1

PubChem CID 11462
CAS 586-61-8
Molecular Weight (g/mol) 199.09
MDL Number MFCD00039159
SMILES CC(C)C1=CC=C(Br)C=C1
Synonym 1-bromo-4-isopropylbenzene,4-bromocumene,4-bromoisopropylbenzene,p-bromocumene,4-isopropylbromobenzene,benzene, 1-bromo-4-1-methylethyl,p-bromoisopropylbenzene,2-p-bromophenyl propane,cumene, p-bromo,2-4-bromophenyl propane
IUPAC Name 1-bromo-4-propan-2-ylbenzene
InChI Key MOZHUOIQYVYEPN-UHFFFAOYSA-N
Molecular Formula C9H11Br
4,575

2,3-Dimethylbenzaldehyde, 97%

CAS: 5779-93-1 Molecular Formula: C9H10O Molecular Weight (g/mol): 134.178 MDL Number: MFCD00798004 InChI Key: UIFVCPMLQXKEEU-UHFFFAOYSA-N Synonym: benzaldehyde, dimethyl,hemellitaldehyde,dimethylbenzaldehyde,o-xylene-3-carboxaldehyde,dimethylformylbenzene,xylene-formaldehyde,pubchem3080,acmc-1ake8,2,3-dimethyl-benzaldehyde,2,3-dimethyl benzaldehyde PubChem CID: 34224 IUPAC Name: 2,3-dimethylbenzaldehyde SMILES: CC1=CC=CC(=C1C)C=O

PubChem CID 34224
CAS 5779-93-1
Molecular Weight (g/mol) 134.178
MDL Number MFCD00798004
SMILES CC1=CC=CC(=C1C)C=O
Synonym benzaldehyde, dimethyl,hemellitaldehyde,dimethylbenzaldehyde,o-xylene-3-carboxaldehyde,dimethylformylbenzene,xylene-formaldehyde,pubchem3080,acmc-1ake8,2,3-dimethyl-benzaldehyde,2,3-dimethyl benzaldehyde
IUPAC Name 2,3-dimethylbenzaldehyde
InChI Key UIFVCPMLQXKEEU-UHFFFAOYSA-N
Molecular Formula C9H10O